2-(butanoylamino)-4-(4-propan-2-ylphenyl)thiophene-3-carboxylate

Systemtic Name: 2-(butanoylamino)-4-(4-propan-2-ylphenyl)thiophene-3-carboxylate Openeye Name: 2-(butanoylamino)-4-(4-isopropylphenyl)thiophene-3-carboxylate CAS Name: 2-(1-oxobutylamino)-4-(4-propan-2-ylphenyl)-3-thiophenecarboxylate IUPAC Name: 2-(butanoylamino)-4-(4-propan-2-ylphenyl)thiophene-3-carboxylate Traditional Name: 2-butyramido-4-p-cumenyl-3-thenoate Formula: C18H20NO3S- MolecularWeight: 330.4213

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)C(C)C)C(=O)[O-]

Isomeric SMILES

CCCC(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)C(C)C)C(=O)[O-]

InChI

InChI=1S/C18H21NO3S/c1-4-5-15(20)19-17-16(18(21)22)14(10-23-17)13-8-6-12(7-9-13)11(2)3/h6-11H,4-5H2,1-3H3,(H,19,20)(H,21,22)/p-1